SCHEMBL3314880

SCHEMBL3314880

O=C(NCc1ccccc1)Nc1ccc(-n2ccnc2)c(F)c1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 7/20 0.57
BLM P54132 1/20 0.57
IMPDH2 P12268 1/20 0.53
ROCK2 O75116 2/20 0.52
ROCK1 Q13464 2/20 0.52
HTT P42858 1/20 0.50
KDR P35968 1/20 0.50
LMNA P02545 1/20 0.47
NPC1 O15118 1/20 0.47
POLB P06746 1/20 0.47
MAOB P27338 1/20 0.47
RAB9A P51151 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
GSK3B P49841 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7841588 0.81 POLB (0.54) NAMPTBLMROCK2HTTLMNA
SCHEMBL13972684 0.78 BLM (0.62) BLMLMNAMEN1KMT2A
SCHEMBL8822060 0.77 POLB (0.48) BLMROCK2HTTLMNANPC1
SCHEMBL16370184 0.76 EPHX2 (0.57) NAMPTLMNANPC1RAB9AMEN1
SCHEMBL4357696 0.76 NAMPT (0.59) NAMPTIMPDH2ROCK2ROCK1HTT
SCHEMBL23316549 0.75 BLM (0.46) BLM
SCHEMBL18069354 0.75 BLM (0.46) BLMKMT2A
SCHEMBL16370015 0.74 LMNA (0.57) NAMPTLMNANPC1RAB9AMEN1
SCHEMBL16370228 0.74 NAMPT (0.48) NAMPTLMNAMEN1KMT2A
SCHEMBL19910597 0.74 BLM (0.44) BLM

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100105904-A1 UREA TYPE CINNAMIDE DERIVATIVE EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-04-29 US disclosed
US-20100105904-A1 UREA TYPE CINNAMIDE DERIVATIVE EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-04-29 US disclosed
US-20100105904-A1 UREA TYPE CINNAMIDE DERIVATIVE EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-04-29 US disclosed
CN-101448793-A Urea type cinnamamide derivative EISAI R&D MAN CO LTD (JP) 2009-06-03 CN disclosed
EP-2019093-A1 UREA TYPE CINNAMIDE DERIVATIVE Eisai R&D Management Co., Ltd. (JP) 2009-01-28 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100105904-A1 UREA TYPE CINNAMIDE DERIVATIVE SLC14A1, UTS2R, MAN2B1 NAMPT 3762/4885BLM 4392/4885IMPDH2 1442/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.